SCHEMBL2395780

SCHEMBL2395780

CC(C)(C)OC(=O)Nc1cncc(-c2n[nH]c3cnc4ccc(-c5cccnc5)cc4c23)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 16/20 0.48
▸ CLK2 P49760 13/20 0.48
▸ CLK3 P49761 13/20 0.48
▸ WNT1 P04628 3/20 0.44
▸ MAP4K4 O95819 1/20 0.43
▸ CYP17A1 P05093 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2396769 0.85 MTOR (0.42) DYRK1ACLK2CLK3WNT1MAP4K4
SCHEMBL1558291 0.82 DYRK1A (0.51) DYRK1ACLK2CLK3WNT1MAP4K4
SCHEMBL1559354 0.79 PIM1 (0.58) DYRK1ACLK2CLK3WNT1MAP4K4
SCHEMBL6756707 0.78 NAMPT (0.60) DYRK1ACYP17A1
SCHEMBL1560027 0.78 DYRK1A (0.46) DYRK1ACLK2CLK3WNT1MAP4K4
SCHEMBL2397747 0.77 CLK2 (0.51) DYRK1ACLK2CLK3WNT1
SCHEMBL2399375 0.77 TTK (0.50) DYRK1ACLK2CLK3WNT1
SCHEMBL13362151 0.76 DYRK1A (0.56) DYRK1ACLK2CLK3WNT1MAP4K4
SCHEMBL1558271 0.76 MAPK10 (0.57) DYRK1ACLK2CLK3WNT1MAP4K4
SCHEMBL2394463 0.74 PIM1 (0.45) DYRK1ACLK2CLK3WNT1MAP4K4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
WO-2009155527-A9 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2010-05-06 — — WO disclosed
WO-2009155527-A9 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2010-05-06 — — WO disclosed
WO-2009155527-A2 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2009-12-23 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PIK3CA, AKT1, PIK3R5 DYRK1A 360/4885CLK2 408/4885CLK3 506/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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